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Nouretdinov, I., Devetyarov, D., Vovk, V., Burford, B., Camuzeaux, S., Gentry-Maharaj, A., Tiss, A., Smith, C., Luo, Z., Chervonenkis, A., Hallett, R., Waterfield, M., Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511, Timms, J. F., Jacobs, I., Menon, U. and Gammerman, A. (2015) Multiprobabilistic prediction in early medical diagnoses. Annals of Mathematics and Artificial Intelligence, 74 (1-2). pp. 203-222. ISSN 1573-7470 doi: https://doi.org/10.1007/s10472-013-9367-5

Ontaneda, J., Bennett, R. ORCID: https://orcid.org/0000-0001-6266-3510 and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2015) Electronic structure of Pd multi-layers on Re(0001): the role of charge transfer. Journal of Physical Chemistry C, 119 (41). pp. 23436-23444. ISSN 1932-7447 doi: https://doi.org/10.1021/acs.jpcc.5b06070

Osorio, H.M., Catarelli, S., Cea, P., Gluyas, J.G.B., Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360, Higgins, S.J., Leary, E., Low, P.J., Martín, S., Nichols, R.J., Tory, J., Ulstrup, J., Vezzoli, A., Milan, D.C. and Zeng, Q. (2015) Electrochemical single-molecule transistors with optimized gate coupling. Journal of the American Chemical Society, 137 (45). pp. 14319-14328. ISSN 0002-7863 doi: https://doi.org/10.1021/jacs.5b08431

Praetorius, C., Zinner, M., Held, G. and Fauth, K. (2015) Surface termination of CePt5/Pt(111): the key to chemical inertness. Physical Review B, 92 (19). 195427. ISSN 1098-0121 doi: https://doi.org/10.1103/PhysRevB.92.195427

Richardson, S. J., Staniec, P. A., Newby, G. E., Rawle, J. L., Slaughter, A. R., Terrill, N. J., Elliott, J. ORCID: https://orcid.org/0000-0001-7469-4154 and Squires, A. (2015) Glycerol prevents dehydration in lipid cubic phases. Chemical Communications, 51 (57). pp. 11386-11389. ISSN 1359-7345 doi: https://doi.org/10.1039/c5cc03771a

Santos-Carballal, D., Roldan, A., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and de Leeuw, N.H. (2015) First-principles study of the inversion thermodynamics and electronic structure of FeM2X4 (thio)spinels (M = Cr, Mn, Co, Ni; X = O, S). Physical Review B, 91 (19). 195106. ISSN 1550-235X doi: https://doi.org/10.1103/PhysRevB.91.195106

Sebastiani, F., Campbell, R. A. and Pfrang, C. (2015) Complementarity of neutron reflectometry and ellipsometry for the study of atmospheric reactions at the air–water interface. RSC Advances, 5 (129). pp. 107105-107111. ISSN 2046-2069 doi: https://doi.org/10.1039/c5ra22725a

Sengupta, D., Gangopadhyay, S., Drew, M. G. B. and Gangopadhyay, P. K. (2015) Thiohydrazide complexes of molybdenum and their relevance to reduction of dinitrogen to ammonia. Dalton Transactions, 44 (3). pp. 1323-1331. ISSN 1364-5447 doi: https://doi.org/10.1039/c4dt01945h

Shirodkar, S. N., Waghmare, U. V., Fisher, T. S. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2015) Engineering the electronic bandgaps and band edge positions in carbon-substituted 2D boron nitride: a first-principles investigation. Physical Chemistry Chemical Physics, 17 (20). pp. 13547-13552. ISSN 1463-9076 doi: https://doi.org/10.1039/C5CP01680K

Singh, U., Spink, M., Davis, F. ORCID: https://orcid.org/0000-0003-0462-872X and Mitchell, G. (2015) Morphology of polymer networks formed in the chiral and non chiral phases of an anti-ferroelectric liquid crystal. Chemical Physics Letters, 641. pp. 80-83. ISSN 0009-2614 doi: https://doi.org/10.1016/j.cplett.2015.10.047

Spillman, M. J., Shankland, K. ORCID: https://orcid.org/0000-0001-6566-0155, Williams, A. C. ORCID: https://orcid.org/0000-0003-3654-7916 and Cole, J. C. (2015) CDASH: a cloud-enabled program for structure solution from powder diffraction data. Journal of Applied Crystallography, 48 (6). pp. 2033-2039. ISSN 0021-8898 doi: https://doi.org/10.1107/S160057671502049X

Squires, A. M., Akbar, S., Tousley, M. E., Rokhlenko, Y., Singer, J. P. and Osuji, C. O. (2015) Experimental evidence for proposed transformation pathway from the inverse hexagonal to inverse diamond cubic phase from oriented lipid samples. Langmuir, 31 (28). pp. 7707-7711. ISSN 0743-7463 doi: https://doi.org/10.1021/acs.langmuir.5b01676

Tang, X., Siviour, C. R., Buckley, C. P., Feula, A. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2015) Effect of temperature and strain rate on the compressive behaviour of supramolecular polyurethane. EPJ Web of Conferences, 94. 01046. ISSN 2100-014X doi: https://doi.org/10.1051/epjconf/20159401046

Tena-Solsona, M., Escuder, B., Miravet, J. F., Castelletto, V., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 and Dehsorkhi, A. (2015) Thermodynamic and kinetic study of the fibrillization of a family of tetrapeptides and its application to self-sorting: what takes so long? Chemistry of Materials, 27 (9). pp. 3358-3365. ISSN 1520-5002 doi: https://doi.org/10.1021/acs.chemmater.5b00580

Thompson, P. B. J., Nguyen, B. N., Nicholls, R., Bourne, R. A., Brazier, J. B., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X, Brown, S. D., Wermeille, D., Bikondoa, O., Lucas, C. A., Hase, T. P. A. and Newton, M. A. (2015) X-ray spectroscopy for chemistry in the 2-4 keV energy regime at the XMaS beamline: ionic liquids, Rh and Pd catalysts in gas and liquid environments, and Cl contamination in γ-Al2O3. Journal of Synchrotron Radiation, 22 (6). pp. 1426-1439. ISSN 0909-0495 doi: https://doi.org/10.1107/s1600577515016148

Tillotson, M., Brett, P., Bennett, R. A. ORCID: https://orcid.org/0000-0001-6266-3510 and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2015) Adsorption of organic molecules at the TiO2(110) surface: the effect of van der Waals interactions. Surface Science, 632 (142). pp. 142-153. ISSN 0039-6028 doi: https://doi.org/10.1016/j.susc.2014.09.017

Toro-Funes, N., Morales-Gutiérrez, F. J., Veciana-Nogués, M. T., Vidal-Carou, M. C., Spencer, J. P. E. ORCID: https://orcid.org/0000-0003-2931-7274 and Rodriguez-Mateos, A. (2015) The intracellular metabolism of isoflavones in endothelial cells. Food & Function, 6 (1). pp. 97-107. ISSN 2042-650X doi: https://doi.org/10.1039/c4fo00772g

Tory, J., Setterfield-Price, B., Dryfe, R. A. W. and Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 (2015) [M(CO)4(2,2′-bipyridine)] (M = Cr, Mo, W) as efficient catalysts for electrochemical reduction of CO2 to CO at a gold electrode. ChemElectroChem, 2 (2). pp. 213-217. ISSN 2196-0216 doi: https://doi.org/10.1002/celc.201402282

Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262, Al Orabi, R. A. R., Luu, S. D. N., Guelou, G., Powell, A. V., Smith, R. I., Song, J. P., Wee, D. and Fornari, M. (2015) The role of copper in the thermal conductivity of thermoelectric oxychalcogenides: do lone pairs matter? Physical Chemistry Chemical Physics, 17 (47). pp. 31735-31740. ISSN 1463-9076 doi: https://doi.org/10.1039/C5CP06192J

Vats, B., Kannan, S., Sundararajan, M., Kumar, M. and Drew, M. G. B. (2015) Synthesis, structural and theoretical studies of dithiodiglycolamide compounds of palladium(ii). Dalton Transactions, 44 (26). pp. 11867-11876. ISSN 1477-9234 doi: https://doi.org/10.1039/c4dt03814b

Vilaça, H., Hortelão, A. C. L., Castanheira, E. M. S., Queiroz, M.-J. R. P., Hilliou, L., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Martins, J. A. and Ferreira, P. M. T. (2015) Dehydrodipeptide hydrogelators containing naproxen N‑Capped tryptophan: self-assembly, hydrogel characterization, and evaluation as potential drug nanocarriers. Biomacromolecules, 16 (11). pp. 3562-3573. ISSN 1525-7797 doi: https://doi.org/10.1021/acs.biomac.5b01006

Villar-Garcia, I. J., Fearn, S., Ismail, N. L., McIntosh, A. J. S. and Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X (2015) Fine tuning the ionic liquid–vacuum outer atomic surface using ion mixtures. Chemical Communications, 51 (25). pp. 5367-5370. ISSN 1359-7345 doi: https://doi.org/10.1039/c4cc06307d

Wiangnon, K. and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2015) Sample preparation: a crucial factor for the analytical performance of rationally designed MALDI matrices. Analytical Chemistry, 87 (3). pp. 1485-1488. ISSN 0003-2700 doi: https://doi.org/10.1021/ac504412p

Woodruff, D. P., Ledieu, J., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X, Jones, R. G., Deyko, A., Wearing, L. H., McGrath, R., Chaudhuri, A., Li, H. I., Su, S. Y., Mayer, A., Stanisha, N. A. and Diehl, R. D. (2015) X-ray standing wave study of Si clusters on a decagonal Al-Co-Ni quasicrystal surface. Physical Review B, 91 (11). 115418. ISSN 1098-0121 doi: https://doi.org/10.1103/PhysRevB.91.115418

Yadav, M. K., Rajput, G., Prasad, L. B., Drew, M. G. B. and Singh, N. (2015) Rare intermolecular M⋯H–C anagostic interactions in homoleptic Ni(ii)–Pd(ii) dithiocarbamate complexes. New Journal of Chemistry, 39 (7). pp. 5493-5499. ISSN 1369-9261 doi: https://doi.org/10.1039/c5nj00452g

Yadav, M. K., Rajput, G., Srivastava, K., Singh, R. K., Mishra, R., Drew, M. and Singh, N. (2015) Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes. New Journal of Chemistry, 39 (8). pp. 6358-6366. ISSN 1369-9261 doi: https://doi.org/10.1039/c5nj00765h

Zeng, Q., Lewis, F. W., Harwood, L. M. ORCID: https://orcid.org/0000-0002-8442-7380 and Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 (2015) Role of ligands in catalytic water oxidation by mononuclear ruthenium complexes. Coordination Chemistry Reviews, 304-305. pp. 88-101. ISSN 0010-8545 doi: https://doi.org/10.1016/j.ccr.2015.03.003

Zhang, J., Zhang, M.-X., Sun, C.-F., Xu, M., Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360, Yin, J., Yu, G. A., Rao, L. and Liu, S. H. (2015) Diruthenium complexes with bridging diethynyl polyaromatic ligands: synthesis, spectroelectrochemistry, and theoretical calculations. Organometallics, 34 (16). pp. 3967-3978. ISSN 1520-6041 doi: https://doi.org/10.1021/acs.organomet.5b00276

da Silva, E. R., Walter, M. N. M., Reza, M., Castelletto, V., Ruokolainen, J., Connon, C. J., Alves, W. A. and Hamley, I. W. (2015) Self-assembled arginine-capped peptide bolaamphiphile nanosheets for cell culture and controlled wettability surfaces. Biomacromolecules, 16 (10). pp. 3180-3190. ISSN 1525-7797 doi: https://doi.org/10.1021/acs.biomac.5b00820

Book or Report Section

Greenland, B. W. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2015) Donor-acceptor π−π stacking interactions: from small molecule complexes to healable supramolecular polymer networks. In: Supramolecular polymer networks and gels. Advances in Polymer Science. Springer, pp. 143-166.

Lignou, S. ORCID: https://orcid.org/0000-0001-6971-2258, Parker, J. K. ORCID: https://orcid.org/0000-0003-4121-5481, Hurr, B., Garcia, P., Baxter, C. and Mottram, D. S. (2015) Quality characteristics of six Charentais cantaloupe genotypes during storage. In: Flavour Science. Context Products, pp. 503-506.

Conference or Workshop Item

Nazhipkyzy, M., Mohan, S. D., Davis, F. J. ORCID: https://orcid.org/0000-0003-0462-872X and Mitchell, G. R. (2015) Carbon nanotubes in electrospun polyethylene oxide nanofibres: a potential route to conducting nanofibres. In: Electrostatics 2015, 12–16 April 2015, Southampton.

Thesis

Jones, S. M. (2015) High performance polyester-based materials. PhD thesis, University of Reading.